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Ligand · E2B

E2B · 3-{[(9beta,14beta,16alpha,17alpha)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl]methyl}benzamide

E2B, 3-{[(9beta,14beta,16alpha,17alpha)-3,17-dihydroxyestra-1,3,5(10)-trien-16-yl]methyl}benzamide (C26 H31 N O3, 405.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues…

Component
E2B
Formula
C26 H31 N O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

E2B in 4 structures; the first of them:

  • 3HB4 · 17beta-hydroxysteroid dehydrogenase type1 complexed with E2B · E2B X700 · binds GLY94, LEU95, SER142, VAL143, GLY144, LEU149, ASN152, TYR155 and 14 more
  • 3HB5 · Binary and ternary crystal structures of a novel inhibitor of 17 beta-HSD type 1: a lead… · E2B X700 · binds GLY94, LEU95, LEU96, SER142, VAL143, GLY144, LEU149, ASN152 and 17 more
  • 3HB4 · 17BETA-hydroxysteroid dehydrogenase TYPE1 complexed with E2B · E2B X700 · binds GLY94, LEU95, SER142, VAL143, GLY144, LEU149, ASN152, TYR155 and 14 more
  • 3HB5 · Binary and ternary crystal structures of a novel inhibitor of 17 beta- hsd type 1: a lead… · E2B X700 · binds GLY94, LEU95, LEU96, SER142, VAL143, GLY144, LEU149, ASN152 and 17 more

Residues it binds most

VAL 4, GLY 4, LEU 4, PHE 4, MET 4, SER 4, TYR 4, ASN 4, CYS 4, GLU 4 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate

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